General Information of the Compound
| Compound ID |
CP0467014
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| Compound Name |
N-hydroxy-N-[3-[1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazol-3-yl]prop-2-ynyl]pyridine-4-carboxamide
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| Structure |
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| Formula |
C26H22N4O3
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| Molecular Weight |
438.487
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| Canonical SMILES |
COc1ccc(cc1)-n1nc(cc1-c1ccc(C)cc1)C#CCN(O)C(=O)c1ccncc1
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| InChI |
InChI=1S/C26H22N4O3/c1-19-5-7-20(8-6-19)25-18-22(28-30(25)23-9-11-24(33-2)12-10-23)4-3-17-29(32)26(31)21-13-15-27-16-14-21/h5-16,18,32H,17H2,1-2H3
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| InChIKey |
ZCQVKNPBTMNOQD-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound